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CHEBI:180709 - 3,4,5-trihydroxy-6-{[(2E)-2-methyl-3-phenylprop-2-en-1-yl]oxy}oxane-2-carboxylic acid

ChEBI IDCHEBI:180709
ChEBI Name3,4,5-trihydroxy-6-{[(2E)-2-methyl-3-phenylprop-2-en-1-yl]oxy}oxane-2-carboxylic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O7
Net Charge0
Average Mass324.329
Monoisotopic Mass324.12090
SMILESC/C(=C\c1ccccc1)COC1OC(C(=O)O)C(O)C(O)C1O
InChIInChI=1S/C16H20O7/c1-9(7-10-5-3-2-4-6-10)8-22-16-13(19)11(17)12(18)14(23-16)15(20)21/h2-7,11-14,16-19H,8H2,1H3,(H,20,21)/b9-7+
InChIKeyBNDCTQVWCQSGSJ-VQHVLOKHSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood serum (BTO:0000133) Article
ChEBI Ontology
Outgoing Relation(s)
3,4,5-trihydroxy-6-{[(2E)-2-methyl-3-phenylprop-2-en-1-yl]oxy}oxane-2-carboxylic acid (CHEBI:180709) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
3,4,5-trihydroxy-6-[(E)-2-methyl-3-phenylprop-2-enoxy]oxane-2-carboxylic acid
Manual XrefsDatabases
HMDB0133619HMDB